2-(1,3-benzothiazol-2-ylsulfanyl)-N-[(2,4,5-trimethoxyphenyl)methyl]ethanamide

Systemtic Name: 2-(1,3-benzothiazol-2-ylsulfanyl)-N-[(2,4,5-trimethoxyphenyl)methyl]ethanamide Openeye Name: 2-(1,3-benzothiazol-2-ylsulfanyl)-N-[(2,4,5-trimethoxyphenyl)methyl]acetamide CAS Name: 2-(1,3-benzothiazol-2-ylthio)-N-[(2,4,5-trimethoxyphenyl)methyl]acetamide IUPAC Name: 2-(1,3-benzothiazol-2-ylsulfanyl)-N-[(2,4,5-trimethoxyphenyl)methyl]acetamide Traditional Name: 2-(1,3-benzothiazol-2-ylthio)-N-(2,4,5-trimethoxybenzyl)acetamide Formula: C19H20N2O4S2 MolecularWeight: 404.5031

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Descriptors Computed from Structure

Canonical SMILES:

COC1=CC(=C(C=C1CNC(=O)CSC2=NC3=CC=CC=C3S2)OC)OC

Isomeric SMILES

COC1=CC(=C(C=C1CNC(=O)CSC2=NC3=CC=CC=C3S2)OC)OC

InChI

InChI=1S/C19H20N2O4S2/c1-23-14-9-16(25-3)15(24-2)8-12(14)10-20-18(22)11-26-19-21-13-6-4-5-7-17(13)27-19/h4-9H,10-11H2,1-3H3,(H,20,22)